2-butoxy-7-chloranyl-N-[3-(2-chloroethylsulfanyl)propyl]benzo[b][1,5]naphthyridin-10-amine

Systemtic Name: 2-butoxy-7-chloranyl-N-[3-(2-chloroethylsulfanyl)propyl]benzo[b][1,5]naphthyridin-10-amine Openeye Name: 2-butoxy-7-chloro-N-[3-(2-chloroethylsulfanyl)propyl]benzo[b][1,5]naphthyridin-10-amine CAS Name: 2-butoxy-7-chloro-N-[3-(2-chloroethylthio)propyl]-10-benzo[b][1,5]naphthyridinamine IUPAC Name: 2-butoxy-7-chloro-N-[3-(2-chloroethylsulfanyl)propyl]benzo[b][1,5]naphthyridin-10-amine Traditional Name: (2-butoxy-7-chloro-benzo[b][1,5]naphthyridin-10-yl)-[3-(2-chloroethylthio)propyl]amine Formula: C21H25Cl2N3OS MolecularWeight: 438.4137

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCSCCCl

Isomeric SMILES

CCCCOC1=NC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCSCCCl

InChI

InChI=1S/C21H25Cl2N3OS/c1-2-3-11-27-19-8-7-17-21(26-19)20(24-10-4-12-28-13-9-22)16-6-5-15(23)14-18(16)25-17/h5-8,14H,2-4,9-13H2,1H3,(H,24,25)